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TitleMicrobial-host-isozyme analyses reveal microbial DPP4 as a potential antidiabetic target.
Journal, issue, pagesScience, Vol. 381, Page eadd5787-eadd5787, Year 2023
Publish dateJun 14, 2022 (structure data deposition date)
AuthorsWang, K. / Zhang, Z. / Hang, J. / Liu, J. / Guo, F. / Ding, Y. / Li, M. / Nie, Q. / Lin, J. / Zhuo, Y. ...Wang, K. / Zhang, Z. / Hang, J. / Liu, J. / Guo, F. / Ding, Y. / Li, M. / Nie, Q. / Lin, J. / Zhuo, Y. / Sun, L. / Luo, X. / Zhong, Q. / Ye, C. / Yun, C. / Zhang, Y. / Wang, J. / Bao, R. / Pang, Y. / Wang, G. / Gonzalez, F.J. / Lei, X. / Qiao, J. / Jiang, C.
External linksScience / PubMed:37535747
MethodsX-ray diffraction
Resolution1.918 - 2.74 Å
Structure data

PDB-7y4f:
bacterial DPP4
Method: X-RAY DIFFRACTION / Resolution: 1.918 Å

PDB-7y4g:
sit-bound btDPP4
Method: X-RAY DIFFRACTION / Resolution: 1.97 Å

PDB-8hay:
d4-bound btDPP4
Method: X-RAY DIFFRACTION / Resolution: 2.74 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-715:
(2R)-4-OXO-4-[3-(TRIFLUOROMETHYL)-5,6-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]PYRAZIN-7(8H)-YL]-1-(2,4,5-TRIFLUOROPHENYL)BUTAN-2-A / medication, inhibitor*YM

ChemComp-KYL:
(1~{R})-1-[[4-[5-[[(1~{R})-6,7-dimethoxy-2-methyl-3,4-dihydro-1~{H}-isoquinolin-1-yl]methyl]-2-methoxy-phenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1~{H}-isoquinoline

Source
  • bacteroides thetaiotaomicron (bacteria)
KeywordsHYDROLASE / gut microbiota / HYDROLASE/INHIBITOR / HYDROLASE-INHIBITOR complex / peptidase / isozyme / secreted / inhibitor

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